CID 371433

Nsc645655

Structural Information

Molecular Formula
C18H14N4O
SMILES
CC1=NC2=C(N1)C=C(C=C2)N=NC3=C(C=CC4=CC=CC=C43)O
InChI
InChI=1S/C18H14N4O/c1-11-19-15-8-7-13(10-16(15)20-11)21-22-18-14-5-3-2-4-12(14)6-9-17(18)23/h2-10,23H,1H3,(H,19,20)
InChIKey
GFVLBOGSQWCHGO-UHFFFAOYSA-N
Compound name
1-[(2-methyl-3H-benzimidazol-5-yl)diazenyl]naphthalen-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

302.11676 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.12404 167.4
[M+Na]+ 325.10598 178.2
[M-H]- 301.10948 174.6
[M+NH4]+ 320.15058 183.3
[M+K]+ 341.07992 171.5
[M+H-H2O]+ 285.11402 158.0
[M+HCOO]- 347.11496 192.0
[M+CH3COO]- 361.13061 179.7
[M+Na-2H]- 323.09143 176.0
[M]+ 302.11621 169.6
[M]- 302.11731 169.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.